SpectraBase Compound ID | Ij3kwsetHve |
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InChI | InChI=1S/C8H13Cl/c1-7(9)6-8-4-2-3-5-8/h2,4,7-8H,3,5-6H2,1H3 |
InChIKey | JXDRUDDJWILLGV-UHFFFAOYSA-N |
Mol Weight | 144.64 g/mol |
Molecular Formula | C8H13Cl |
Exact Mass | 144.070578 g/mol |
SpectraBase Spectrum ID | 8ipNUEV43Hh |
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Name | Cyclopentene, 3-(2-chloropropyl)-, (R*,R*)- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 144.070578119 u |
Formula | C8H13Cl |
InChI | InChI=1S/C8H13Cl/c1-7(9)6-8-4-2-3-5-8/h2,4,7-8H,3,5-6H2,1H3 |
InChIKey | JXDRUDDJWILLGV-UHFFFAOYSA-N |
Molecular Weight | 144.645 g/mol |
SMILES | C1=CCCC1CC(Cl)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.890123 |